4-[[2-[(4S)-4-benzyl-2,5-dioxo-4-phenylimidazolidin-1-yl]acetyl]amino]benzamide

C25H22N4O4 — CID 2705391

IUPAC4-[[2-[(4S)-4-benzyl-2,5-dioxo-4-phenylimidazolidin-1-yl]acetyl]amino]benzamide
SMILESNC(=O)c1ccc(NC(=O)CN2C(=O)N[C@@](Cc3ccccc3)(c3ccccc3)C2=O)cc1
InChIInChI=1S/C25H22N4O4/c26-22(31)18-11-13-20(14-12-18)27-21(30)16-29-23(32)25(28-24(29)33,19-9-5-2-6-10-19)15-17-7-3-1-4-8-17/h1-14H,15-16H2,(H2,26,31)(H,27,30)(H,28,33)/t25-/m0/s1
InChIKeyJFIHHFIEALEZCM-VWLOTQADSA-N
MW442.48 g/mol
LogP2.41
Rot. Bonds7

About 4-[[2-[(4S)-4-benzyl-2,5-dioxo-4-phenylimidazolidin-1-yl]acetyl]amino]benzamide

4-[[2-[(4S)-4-benzyl-2,5-dioxo-4-phenylimidazolidin-1-yl]acetyl]amino]benzamide (PubChem CID 2705391) has the molecular formula C25H22N4O4 and a molecular weight of 442.48 g/mol. Its IUPAC name is 4-[[2-[(4S)-4-benzyl-2,5-dioxo-4-phenylimidazolidin-1-yl]acetyl]amino]benzamide.

Molecular Properties

Compound Name4-[[2-[(4S)-4-benzyl-2,5-dioxo-4-phenylimidazolidin-1-yl]acetyl]amino]benzamide
PubChem CID2705391
Molecular FormulaC25H22N4O4
Molecular Weight442.48 g/mol
Exact Mass442.16
IUPAC Name4-[[2-[(4S)-4-benzyl-2,5-dioxo-4-phenylimidazolidin-1-yl]acetyl]amino]benzamide
SMILESNC(=O)c1ccc(NC(=O)CN2C(=O)N[C@@](Cc3ccccc3)(c3ccccc3)C2=O)cc1
InChIInChI=1S/C25H22N4O4/c26-22(31)18-11-13-20(14-12-18)27-21(30)16-29-23(32)25(28-24(29)33,19-9-5-2-6-10-19)15-17-7-3-1-4-8-17/h1-14H,15-16H2,(H2,26,31)(H,27,30)(H,28,33)/t25-/m0/s1
InChIKeyJFIHHFIEALEZCM-VWLOTQADSA-N
XLogP2.41
TPSA121.60 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms33
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500442.48
LogP ≤ 52.41
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydantoin', 'substructure': 'N/A'}

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Related Compounds

4-[[2-[(4R)-4-benzyl-2,5-dioxo-4-phenylimidazolidin-1-yl]acetyl]amino]benzamide
CID 2705390
2-(4-benzyl-2,5-dioxo-4-phenylimidazolidin-1-yl)-N-(4-methylphenyl)acetamide
CID 16545157
2-[(4S)-4-benzyl-2,5-dioxo-4-phenylimidazolidin-1-yl]-N-(4-ethoxyphenyl)acetamide
CID 41152635
2-[(4S)-4-benzyl-2,5-dioxo-4-phenylimidazolidin-1-yl]-N-(2-methylphenyl)acetamide
CID 7637654
2-[(4R)-4-benzyl-2,5-dioxo-4-phenylimidazolidin-1-yl]-N-(2-fluorophenyl)acetamide
CID 7637677
(5S)-5-benzyl-3-phenacyl-5-phenylimidazolidine-2,4-dione
CID 7300137
4-[[2-[(4R)-4-ethyl-2,5-dioxo-4-phenylimidazolidin-1-yl]acetyl]amino]-N,N-dimethylbenzamide
CID 2582874
2-[(4R)-4-benzyl-2,5-dioxo-4-phenylimidazolidin-1-yl]-N-(methylcarbamoyl)acetamide
CID 2705361
2-[(4R)-2,5-dioxo-4-phenyl-4-propylimidazolidin-1-yl]-N-(4-ethylphenyl)acetamide
CID 2585532
2-(4-ethyl-2,5-dioxo-4-phenylimidazolidin-1-yl)-N-(4-propylphenyl)acetamide
CID 24565803
2-[(4S)-4-benzyl-2,5-dioxo-4-phenylimidazolidin-1-yl]-N-(2,5-dimethylphenyl)acetamide
CID 40965115
N-(4-chlorophenyl)-2-[(4S)-4-ethyl-2,5-dioxo-4-phenylimidazolidin-1-yl]acetamide
CID 7179775

Frequently Asked Questions

What is the IUPAC name of 4-[[2-[(4S)-4-benzyl-2,5-dioxo-4-phenylimidazolidin-1-yl]acetyl]amino]benzamide?
The IUPAC name of 4-[[2-[(4S)-4-benzyl-2,5-dioxo-4-phenylimidazolidin-1-yl]acetyl]amino]benzamide (CID 2705391) is 4-[[2-[(4S)-4-benzyl-2,5-dioxo-4-phenylimidazolidin-1-yl]acetyl]amino]benzamide.
What is the SMILES notation for 4-[[2-[(4S)-4-benzyl-2,5-dioxo-4-phenylimidazolidin-1-yl]acetyl]amino]benzamide?
The canonical SMILES for 4-[[2-[(4S)-4-benzyl-2,5-dioxo-4-phenylimidazolidin-1-yl]acetyl]amino]benzamide is NC(=O)c1ccc(NC(=O)CN2C(=O)N[C@@](Cc3ccccc3)(c3ccccc3)C2=O)cc1.
What is the InChIKey of 4-[[2-[(4S)-4-benzyl-2,5-dioxo-4-phenylimidazolidin-1-yl]acetyl]amino]benzamide?
The InChIKey is JFIHHFIEALEZCM-VWLOTQADSA-N. The full InChI is InChI=1S/C25H22N4O4/c26-22(31)18-11-13-20(14-12-18)27-21(30)16-29-23(32)25(28-24(29)33,19-9-5-2-6-10-19)15-17-7-3-1-4-8-17/h1-14H,15-16H2,(H2,26,31)(H,27,30)(H,28,33)/t25-/m0/s1.
What are the key properties of 4-[[2-[(4S)-4-benzyl-2,5-dioxo-4-phenylimidazolidin-1-yl]acetyl]amino]benzamide?
4-[[2-[(4S)-4-benzyl-2,5-dioxo-4-phenylimidazolidin-1-yl]acetyl]amino]benzamide has a molecular weight of 442.48 g/mol, XLogP of 2.41, 7 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[[2-[(4S)-4-benzyl-2,5-dioxo-4-phenylimidazolidin-1-yl]acetyl]amino]benzamide is sourced from PubChem (CID 2705391), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).